V0N
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C1 | N2 | sing | 1.47Å | 1.48Å | |
C1 | C16 | sing | 1.53Å | 1.52Å | |
C1 | H1 | sing | 1.09Å | 1.10Å | |
C1 | H1A | sing | 1.09Å | 1.10Å | |
C2 | C16 | sing | 1.53Å | 1.53Å | |
C2 | C19 | sing | 1.51Å | 1.52Å | |
C2 | H2 | sing | 1.09Å | 1.10Å | |
C2 | H2A | sing | 1.09Å | 1.10Å | |
N2 | C3 | sing | 1.48Å | 1.49Å | |
N2 | C6 | sing | 1.47Å | 1.48Å | |
C3 | C4 | sing | 1.55Å | 1.53Å | |
C3 | C11 | sing | 1.53Å | 1.53Å | |
C3 | H3 | sing | 1.09Å | 1.10Å | |
C4 | C5 | sing | 1.55Å | 1.51Å | |
C4 | O8 | sing | 1.43Å | 1.43Å | |
C4 | H4 | sing | 1.09Å | 1.10Å | |
C5 | C6 | sing | 1.54Å | 1.51Å | |
C5 | O7 | sing | 1.43Å | 1.42Å | |
C5 | H5 | sing | 1.09Å | 1.10Å | |
C6 | C9 | sing | 1.53Å | 1.53Å | |
C6 | H6 | sing | 1.09Å | 1.10Å | |
O7 | HO7 | sing | 0.97Å | 0.95Å | |
O8 | HO8 | sing | 0.97Å | 0.95Å | |
C9 | O10 | sing | 1.43Å | 1.43Å | |
C9 | H9 | sing | 1.09Å | 1.10Å | |
C9 | H9A | sing | 1.09Å | 1.10Å | |
O10 | HO10 | sing | 0.97Å | 0.95Å | |
C11 | C12 | sing | 1.51Å | 1.51Å | |
C11 | H11 | sing | 1.09Å | 1.10Å | |
C11 | H11A | sing | 1.09Å | 1.10Å | |
C12 | N13 | sing | 1.35Å | 1.33Å | |
C12 | O15 | doub | 1.21Å | 1.22Å | |
N13 | C14 | sing | 1.47Å | 1.45Å | |
N13 | HN13 | sing | 0.97Å | 1.00Å | |
C14 | H14 | sing | 1.09Å | 1.10Å | |
C14 | H14A | sing | 1.09Å | 1.10Å | |
C14 | H14B | sing | 1.09Å | 1.10Å | |
C16 | H16 | sing | 1.09Å | 1.10Å | |
C16 | H16A | sing | 1.09Å | 1.10Å | |
C19 | C20 | doub | 1.38Å | 1.39Å | Aromatic |
C19 | C24 | sing | 1.38Å | 1.39Å | Aromatic |
C20 | C21 | sing | 1.38Å | 1.39Å | Aromatic |
C20 | H20 | sing | 1.08Å | 1.08Å | |
C21 | C22 | doub | 1.38Å | 1.39Å | Aromatic |
C21 | H21 | sing | 1.08Å | 1.08Å | |
C22 | C23 | sing | 1.38Å | 1.39Å | Aromatic |
C22 | F25 | sing | 1.35Å | 1.34Å | |
C23 | C24 | doub | 1.38Å | 1.39Å | Aromatic |
C23 | H23 | sing | 1.08Å | 1.08Å | |
C24 | H24 | sing | 1.08Å | 1.08Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
N2 | C1 | C16 | 113.9° | 109.5° |
N2 | C1 | H1 | 108.3° | 109.5° |
N2 | C1 | H1A | 108.3° | 109.5° |
C1 | N2 | C3 | 109.7° | 111.0° |
C1 | N2 | C6 | 111.0° | 111.0° |
C16 | C1 | H1 | 108.3° | 109.5° |
C16 | C1 | H1A | 108.4° | 109.4° |
C1 | C16 | C2 | 107.5° | 109.5° |
C1 | C16 | H16 | 110.0° | 109.5° |
C1 | C16 | H16A | 110.0° | 109.5° |
H1 | C1 | H1A | 109.5° | 109.5° |
C16 | C2 | C19 | 118.0° | 109.5° |
C16 | C2 | H2 | 107.3° | 109.5° |
C16 | C2 | H2A | 107.3° | 109.5° |
C2 | C16 | H16 | 110.0° | 109.5° |
C2 | C16 | H16A | 110.0° | 109.5° |
C19 | C2 | H2 | 107.3° | 109.4° |
C19 | C2 | H2A | 107.3° | 109.5° |
C2 | C19 | C20 | 116.6° | 120.0° |
C2 | C19 | C24 | 124.2° | 119.9° |
H2 | C2 | H2A | 109.5° | 109.5° |
C3 | N2 | C6 | 105.5° | 108.6° |
N2 | C3 | C4 | 107.3° | 104.8° |
N2 | C3 | C11 | 113.6° | 110.4° |
N2 | C3 | H3 | 107.8° | 110.3° |
N2 | C6 | C5 | 102.6° | 107.2° |
N2 | C6 | C9 | 117.3° | 109.9° |
N2 | C6 | H6 | 108.6° | 109.9° |
C4 | C3 | C11 | 113.3° | 110.3° |
C4 | C3 | H3 | 107.3° | 110.3° |
C3 | C4 | C5 | 100.9° | 101.6° |
C3 | C4 | O8 | 113.5° | 111.0° |
C3 | C4 | H4 | 109.9° | 111.0° |
C11 | C3 | H3 | 107.2° | 110.5° |
C3 | C11 | C12 | 113.7° | 109.4° |
C3 | C11 | H11 | 108.4° | 109.5° |
C3 | C11 | H11A | 108.4° | 109.5° |
C5 | C4 | O8 | 110.8° | 111.0° |
C5 | C4 | H4 | 110.1° | 111.0° |
C4 | C5 | C6 | 101.4° | 103.0° |
C4 | C5 | O7 | 111.9° | 110.7° |
C4 | C5 | H5 | 109.4° | 110.7° |
O8 | C4 | H4 | 111.2° | 110.9° |
C4 | O8 | HO8 | 109.5° | 114.0° |
C6 | C5 | O7 | 113.6° | 110.7° |
C6 | C5 | H5 | 109.4° | 110.7° |
C5 | C6 | C9 | 111.8° | 109.9° |
C5 | C6 | H6 | 108.2° | 109.9° |
O7 | C5 | H5 | 110.8° | 110.8° |
C5 | O7 | HO7 | 109.5° | 114.0° |
C9 | C6 | H6 | 108.0° | 110.0° |
C6 | C9 | O10 | 110.8° | 109.5° |
C6 | C9 | H9 | 109.1° | 109.5° |
C6 | C9 | H9A | 109.1° | 109.5° |
O10 | C9 | H9 | 109.1° | 109.5° |
O10 | C9 | H9A | 109.1° | 109.5° |
C9 | O10 | HO10 | 109.5° | 114.0° |
H9 | C9 | H9A | 109.5° | 109.5° |
C12 | C11 | H11 | 108.4° | 109.5° |
C12 | C11 | H11A | 108.4° | 109.4° |
C11 | C12 | N13 | 115.6° | 120.0° |
C11 | C12 | O15 | 121.8° | 120.0° |
H11 | C11 | H11A | 109.5° | 109.5° |
N13 | C12 | O15 | 122.6° | 120.0° |
C12 | N13 | C14 | 121.9° | 120.0° |
C12 | N13 | HN13 | 119.0° | 120.0° |
C14 | N13 | HN13 | 119.0° | 120.0° |
N13 | C14 | H14 | 109.5° | 109.5° |
N13 | C14 | H14A | 109.5° | 109.5° |
N13 | C14 | H14B | 109.5° | 109.5° |
H14 | C14 | H14A | 109.5° | 109.4° |
H14 | C14 | H14B | 109.5° | 109.5° |
H14A | C14 | H14B | 109.5° | 109.4° |
H16 | C16 | H16A | 109.4° | 109.4° |
C20 | C19 | C24 | 119.3° | 120.0° |
C19 | C20 | C21 | 120.8° | 120.1° |
C19 | C20 | H20 | 119.6° | 119.9° |
C19 | C24 | C23 | 120.0° | 120.0° |
C19 | C24 | H24 | 120.0° | 120.0° |
C21 | C20 | H20 | 119.6° | 120.0° |
C20 | C21 | C22 | 119.7° | 120.0° |
C20 | C21 | H21 | 120.2° | 120.0° |
C22 | C21 | H21 | 120.1° | 120.0° |
C21 | C22 | C23 | 119.9° | 120.0° |
C21 | C22 | F25 | 120.0° | 120.0° |
C23 | C22 | F25 | 120.1° | 120.0° |
C22 | C23 | C24 | 120.3° | 120.0° |
C22 | C23 | H23 | 119.8° | 120.0° |
C24 | C23 | H23 | 119.9° | 120.0° |
C23 | C24 | H24 | 120.0° | 120.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
N2 | C1 | C16 | H1 | 120.6° | 120.0° |
N2 | C1 | C16 | H1A | 120.6° | 120.0° |
N2 | C1 | H1 | H1A | 118.0° | 120.0° |
N2 | C1 | C16 | C2 | 170.7° | 178.5° |
C1 | N2 | C3 | C6 | 119.6° | 122.3° |
C1 | N2 | C3 | C4 | 115.9° | 146.4° |
C1 | N2 | C3 | C11 | 118.1° | 94.8° |
C1 | N2 | C3 | H3 | 0.6° | 27.6° |
C1 | N2 | C6 | C5 | 88.0° | 123.3° |
C1 | N2 | C6 | C9 | 34.9° | 3.9° |
C1 | N2 | C6 | H6 | 157.6° | 117.3° |
N2 | C1 | C16 | H16 | 69.6° | 58.5° |
N2 | C1 | C16 | H16A | 51.0° | 61.5° |
C16 | C1 | H1 | H1A | 118.0° | 120.0° |
C1 | C16 | C2 | H16 | 119.7° | 120.0° |
C1 | C16 | C2 | H16A | 119.7° | 120.0° |
C1 | C16 | C2 | C19 | 131.0° | 180.0° |
C1 | C16 | C2 | H2 | 107.8° | 60.0° |
C1 | C16 | C2 | H2A | 9.8° | 60.0° |
C16 | C1 | N2 | C3 | 67.0° | 155.6° |
C16 | C1 | N2 | C6 | 176.9° | 83.5° |
C1 | C16 | H16 | H16A | 120.9° | 119.9° |
H1 | C1 | C16 | C2 | 50.1° | 61.5° |
H1 | C1 | N2 | C3 | 172.4° | 84.4° |
H1 | C1 | N2 | C6 | 56.2° | 36.5° |
H1 | C1 | C16 | H16 | 169.8° | 178.5° |
H1 | C1 | C16 | H16A | 69.6° | 58.5° |
H1A | C1 | C16 | C2 | 68.6° | 58.5° |
H1A | C1 | N2 | C3 | 53.7° | 35.6° |
H1A | C1 | N2 | C6 | 62.5° | 156.5° |
H1A | C1 | C16 | H16 | 51.1° | 61.5° |
H1A | C1 | C16 | H16A | 171.6° | 178.5° |
C16 | C2 | C19 | H2 | 121.2° | 120.0° |
C16 | C2 | C19 | H2A | 121.2° | 120.1° |
C16 | C2 | H2 | H2A | 116.1° | 120.0° |
C2 | C16 | H16 | H16A | 120.9° | 120.0° |
C16 | C2 | C19 | C20 | 156.3° | 89.9° |
C16 | C2 | C19 | C24 | 24.7° | 90.3° |
C19 | C2 | H2 | H2A | 116.1° | 120.0° |
C19 | C2 | C16 | H16 | 11.3° | 60.0° |
C19 | C2 | C16 | H16A | 109.3° | 60.0° |
C2 | C19 | C20 | C24 | 179.0° | 179.8° |
C2 | C19 | C20 | C21 | 179.8° | 180.0° |
C2 | C19 | C20 | H20 | 0.2° | 0.1° |
C2 | C19 | C24 | C23 | 179.7° | 179.8° |
C2 | C19 | C24 | H24 | 0.3° | 0.0° |
H2 | C2 | C16 | H16 | 132.5° | 180.0° |
H2 | C2 | C16 | H16A | 11.9° | 60.0° |
H2 | C2 | C19 | C20 | 35.1° | 30.0° |
H2 | C2 | C19 | C24 | 146.0° | 149.7° |
H2A | C2 | C16 | H16 | 109.9° | 60.0° |
H2A | C2 | C16 | H16A | 129.5° | 180.0° |
H2A | C2 | C19 | C20 | 82.5° | 150.0° |
H2A | C2 | C19 | C24 | 96.5° | 29.8° |
N2 | C3 | C4 | C11 | 126.2° | 118.9° |
N2 | C3 | C4 | H3 | 115.7° | 118.8° |
N2 | C3 | C11 | H3 | 119.0° | 122.3° |
N2 | C3 | C4 | C5 | 24.7° | 37.0° |
N2 | C3 | C4 | O8 | 93.9° | 81.0° |
N2 | C3 | C4 | H4 | 140.9° | 155.1° |
C3 | N2 | C6 | C5 | 30.7° | 0.9° |
C3 | N2 | C6 | C9 | 153.6° | 118.4° |
C3 | N2 | C6 | H6 | 83.6° | 120.4° |
N2 | C3 | C11 | C12 | 42.3° | 78.6° |
N2 | C3 | C11 | H11 | 78.3° | 161.4° |
N2 | C3 | C11 | H11A | 162.9° | 41.3° |
C6 | N2 | C3 | C4 | 3.7° | 24.0° |
C6 | N2 | C3 | C11 | 122.3° | 142.9° |
C6 | N2 | C3 | H3 | 119.0° | 94.7° |
N2 | C6 | C5 | C4 | 46.5° | 22.3° |
N2 | C6 | C5 | C9 | 126.6° | 119.4° |
N2 | C6 | C5 | H6 | 114.6° | 119.4° |
N2 | C6 | C5 | O7 | 166.6° | 140.7° |
N2 | C6 | C5 | H5 | 69.1° | 96.1° |
N2 | C6 | C9 | H6 | 123.0° | 121.1° |
N2 | C6 | C9 | O10 | 78.4° | 69.9° |
N2 | C6 | C9 | H9 | 41.8° | 50.1° |
N2 | C6 | C9 | H9A | 161.4° | 170.1° |
C4 | C3 | C11 | H3 | 118.3° | 122.3° |
C3 | C4 | C5 | O8 | 120.5° | 118.1° |
C3 | C4 | C5 | H4 | 116.1° | 118.1° |
C3 | C4 | O8 | H4 | 124.5° | 123.9° |
C3 | C4 | C5 | C6 | 42.9° | 35.6° |
C3 | C4 | C5 | O7 | 164.3° | 154.0° |
C3 | C4 | C5 | H5 | 72.5° | 82.7° |
C3 | C4 | O8 | HO8 | 180.0° | 180.0° |
C4 | C3 | C11 | C12 | 80.4° | 166.0° |
C4 | C3 | C11 | H11 | 158.9° | 46.0° |
C4 | C3 | C11 | H11A | 40.2° | 74.1° |
C11 | C3 | C4 | C5 | 150.8° | 155.9° |
C11 | C3 | C4 | O8 | 32.3° | 37.9° |
C11 | C3 | C4 | H4 | 92.9° | 86.0° |
C3 | C11 | C12 | H11 | 120.7° | 120.0° |
C3 | C11 | C12 | H11A | 120.6° | 120.0° |
C3 | C11 | H11 | H11A | 118.1° | 120.1° |
C3 | C11 | C12 | N13 | 156.4° | 166.1° |
C3 | C11 | C12 | O15 | 24.3° | 13.9° |
H3 | C3 | C4 | C5 | 91.0° | 81.8° |
H3 | C3 | C4 | O8 | 150.5° | 160.2° |
H3 | C3 | C4 | H4 | 25.3° | 36.3° |
H3 | C3 | C11 | C12 | 161.3° | 43.7° |
H3 | C3 | C11 | H11 | 40.7° | 76.3° |
H3 | C3 | C11 | H11A | 78.1° | 163.6° |
C5 | C4 | O8 | H4 | 122.8° | 123.8° |
C4 | C5 | C6 | O7 | 120.2° | 118.4° |
C4 | C5 | C6 | H5 | 115.5° | 118.4° |
C4 | C5 | O7 | H5 | 122.4° | 123.3° |
C4 | C5 | C6 | C9 | 173.1° | 141.7° |
C4 | C5 | C6 | H6 | 68.2° | 97.1° |
C4 | C5 | O7 | HO7 | 180.0° | 61.5° |
C5 | C4 | O8 | HO8 | 67.3° | 67.7° |
O8 | C4 | C5 | C6 | 77.6° | 82.4° |
O8 | C4 | C5 | O7 | 43.8° | 35.9° |
O8 | C4 | C5 | H5 | 166.9° | 159.2° |
H4 | C4 | C5 | C6 | 159.0° | 153.8° |
H4 | C4 | C5 | O7 | 79.6° | 87.9° |
H4 | C4 | C5 | H5 | 43.5° | 35.4° |
H4 | C4 | O8 | HO8 | 55.5° | 56.1° |
C6 | C5 | O7 | H5 | 123.6° | 123.1° |
C5 | C6 | C9 | H6 | 118.9° | 121.1° |
C6 | C5 | O7 | HO7 | 66.0° | 175.1° |
C5 | C6 | C9 | O10 | 39.7° | 47.8° |
C5 | C6 | C9 | H9 | 159.9° | 167.8° |
C5 | C6 | C9 | H9A | 80.5° | 72.2° |
O7 | C5 | C6 | C9 | 66.8° | 99.9° |
O7 | C5 | C6 | H6 | 52.0° | 21.3° |
H5 | C5 | C6 | C9 | 57.5° | 23.2° |
H5 | C5 | C6 | H6 | 176.3° | 144.5° |
H5 | C5 | O7 | HO7 | 57.6° | 61.8° |
C6 | C9 | O10 | H9 | 120.2° | 120.0° |
C6 | C9 | O10 | H9A | 120.2° | 120.0° |
C6 | C9 | H9 | H9A | 119.4° | 120.0° |
C6 | C9 | O10 | HO10 | 180.0° | 180.0° |
H6 | C6 | C9 | O10 | 158.5° | 169.0° |
H6 | C6 | C9 | H9 | 81.3° | 71.1° |
H6 | C6 | C9 | H9A | 38.3° | 48.9° |
O10 | C9 | H9 | H9A | 119.4° | 120.0° |
H9 | C9 | O10 | HO10 | 59.8° | 60.0° |
H9A | C9 | O10 | HO10 | 59.8° | 60.0° |
C12 | C11 | H11 | H11A | 118.0° | 119.9° |
C11 | C12 | N13 | O15 | 179.3° | 180.0° |
C11 | C12 | N13 | C14 | 178.4° | 180.0° |
C11 | C12 | N13 | HN13 | 1.7° | 0.0° |
H11 | C11 | C12 | N13 | 83.0° | 73.9° |
H11 | C11 | C12 | O15 | 96.3° | 106.1° |
H11A | C11 | C12 | N13 | 35.8° | 46.1° |
H11A | C11 | C12 | O15 | 144.9° | 133.9° |
C12 | N13 | C14 | HN13 | 180.0° | 180.0° |
C12 | N13 | C14 | H14 | 180.0° | 180.0° |
C12 | N13 | C14 | H14A | 60.0° | 60.0° |
C12 | N13 | C14 | H14B | 60.0° | 59.9° |
O15 | C12 | N13 | C14 | 1.0° | 0.0° |
O15 | C12 | N13 | HN13 | 179.0° | 180.0° |
N13 | C14 | H14 | H14A | 120.0° | 120.0° |
N13 | C14 | H14 | H14B | 120.0° | 120.1° |
N13 | C14 | H14A | H14B | 120.0° | 120.0° |
HN13 | N13 | C14 | H14 | 0.0° | 0.0° |
HN13 | N13 | C14 | H14A | 120.0° | 120.0° |
HN13 | N13 | C14 | H14B | 120.0° | 120.0° |
H14 | C14 | H14A | H14B | 120.0° | 120.0° |
C19 | C20 | C21 | H20 | 180.0° | 179.9° |
C19 | C20 | C21 | C22 | 0.4° | 0.0° |
C19 | C20 | C21 | H21 | 179.6° | 180.0° |
C20 | C19 | C24 | C23 | 0.7° | 0.4° |
C20 | C19 | C24 | H24 | 179.3° | 179.8° |
C24 | C19 | C20 | C21 | 0.7° | 0.2° |
C24 | C19 | C20 | H20 | 179.3° | 179.7° |
C19 | C24 | C23 | C22 | 0.4° | 0.4° |
C19 | C24 | C23 | H24 | 180.0° | 179.8° |
C19 | C24 | C23 | H23 | 179.6° | 179.7° |
C20 | C21 | C22 | H21 | 180.0° | 180.0° |
C20 | C21 | C22 | C23 | 0.0° | 0.0° |
C20 | C21 | C22 | F25 | 180.0° | 180.0° |
H20 | C20 | C21 | C22 | 179.6° | 180.0° |
H20 | C20 | C21 | H21 | 0.4° | 0.1° |
C21 | C22 | C23 | F25 | 180.0° | 180.0° |
C21 | C22 | C23 | C24 | 0.0° | 0.2° |
C21 | C22 | C23 | H23 | 180.0° | 180.0° |
H21 | C21 | C22 | C23 | 179.9° | 180.0° |
H21 | C21 | C22 | F25 | 0.0° | 0.0° |
C22 | C23 | C24 | H23 | 180.0° | 179.8° |
C22 | C23 | C24 | H24 | 179.6° | 179.8° |
F25 | C22 | C23 | C24 | 180.0° | 179.8° |
F25 | C22 | C23 | H23 | 0.0° | 0.1° |
H23 | C23 | C24 | H24 | 0.3° | 0.1° |